CID 3008669

2h-quinolizine, octahydro-1-[[(tripropylstannyl)thio]methyl]-, (1r,9ar)-

Structural Information

Molecular Formula
C19H39NSSn
SMILES
CCC[Sn](CCC)(CCC)SC[C@@H]1CCCN2[C@@H]1CCCC2
InChI
InChI=1S/C10H19NS.3C3H7.Sn/c12-8-9-4-3-7-11-6-2-1-5-10(9)11;3*1-3-2;/h9-10,12H,1-8H2;3*1,3H2,2H3;/q;;;;+1/p-1/t9-,10+;;;;/m0..../s1
InChIKey
RYDHMCNOIMNQEC-VQTXXYAFSA-M
Compound name
[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl-tripropylstannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

433.18253 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 434.18981 204.3
[M+Na]+ 456.17175 203.7
[M-H]- 432.17525 203.1
[M+NH4]+ 451.21635 217.4
[M+K]+ 472.14569 198.6
[M+H-H2O]+ 416.17979 195.4
[M+HCOO]- 478.18073 208.6
[M+CH3COO]- 492.19638 215.5
[M+Na-2H]- 454.15720 200.1
[M]+ 433.18198 202.4
[M]- 433.18308 202.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.